(2R,8S)-8-(Cyclopentylmethyl)-2-Hydroperoxy-2-(4-Hydroxybenzyl)-6-(4-Hydroxyphenyl)-7,8-Dihydroimidazo[1,2-A]Pyrazin-3(2H)-One
Properties
| Property | Value |
|---|---|
| Formula | C25H27N3O5 |
| IUPAC Name | (2s,8r)-8-(cyclopentylmethyl)-2-hydroperoxy-6-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methyl]-7,8-dihydroimidazo[1,2-a]pyrazin-3-one |
| Molecular Mass | 449.499 g·mol−1 |
| Heat of Formation | -325.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.96 ± 1.08 D |
| Volume | 536.49 Å 3 |
| Surface Area | 449.49 Å 2 |
| HOMO Energy | -8.41 ± 0.55 eV |
| LUMO Energy | 2.70 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XOSFCMOTHZJUQK-BWKNWUBXSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |